KEGG   DRUG: Monosodium fumarate
Entry
D09832                      Drug                                   
Name
Monosodium fumarate (JAN)
Formula
C4H3O4. Na
Exact mass
137.9929
Mol weight
138.054
Structure
Simcomp
Efficacy
Pharmaceutic aid (acidulant)
Other DBs
CAS: 5873-57-4
PubChem: 124490571
ChEBI: 115087
LigandBox: D09832
KCF data

ATOM        9
            1   C6a C    25.9700  -28.5600
            2   C2b C    27.1600  -29.2600
            3   O6a O    24.7100  -29.2600
            4   O6a O    25.9700  -27.1600
            5   C2b C    28.3500  -28.5600
            6   C6a C    29.6100  -29.2600
            7   O6a O    30.8000  -28.5600 #-
            8   O6a O    29.6100  -30.6600
            9   Z   Na   32.4100  -28.5600 #+
BOND        7
            1     1   2 1
            2     1   3 1
            3     1   4 2
            4     2   5 2
            5     5   6 1
            6     6   7 1
            7     6   8 2

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Drug (1)   
   LigandBox (1)   
Chemical substance (2)   
   PubChem (1)   
   ChEBI (1)   
All databases (3)   

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